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1-benzyl-N-[(2-chloro-4-fluorophenyl)methyl]-5-oxopyrrolidine-2-carboxamide

HCID 42642372
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Basic information

Standard SMILES
O=C(NCc1ccc(F)cc1Cl)C1CCC(=O)N1Cc1ccccc1
InChIKey
RHQHVNCBLRJDET-UHFFFAOYSA-N
Molecular formula
C19H18ClFN2O2
Average molar mass
360.8 g/mol

Names & identifiers

Preferred name
1-benzyl-N-[(2-chloro-4-fluorophenyl)methyl]-5-oxopyrrolidine-2-carboxamide
IUPAC
1-benzyl-N-[(2-chloro-4-fluorophenyl)methyl]-5-oxopyrrolidine-2-carboxamide

Names & synonyms

SCHEMBL2579574

Database identifiers

PubChem CID
42642372

Properties

Computed structural properties

XLogP
2.9
Topological polar surface area
49.4 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
5
Heavy atoms
25
Formal charge
0
Complexity
484

Related reactions

1 records
New reaction record
HRID 87180 reaction equation
HRID 87180As productTraining data from https://doi.org/10.1039/C8SC04228D (2/10)

Compound notes

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